2,2-dimethyl-3,4-dihydrochromen-4-amine

C11H15NO — CID 15338705

IUPAC2,2-dimethyl-3,4-dihydrochromen-4-amine
SMILESCC1(C)CC(N)c2ccccc2O1
InChIInChI=1S/C11H15NO/c1-11(2)7-9(12)8-5-3-4-6-10(8)13-11/h3-6,9H,7,12H2,1-2H3
InChIKeyYSTIIIRGSQEQNH-UHFFFAOYSA-N
MW177.25 g/mol
LogP2.25
Rot. Bonds

About 2,2-dimethyl-3,4-dihydrochromen-4-amine

2,2-dimethyl-3,4-dihydrochromen-4-amine (PubChem CID 15338705) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 2,2-dimethyl-3,4-dihydrochromen-4-amine.

Molecular Properties

Compound Name2,2-dimethyl-3,4-dihydrochromen-4-amine
PubChem CID15338705
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name2,2-dimethyl-3,4-dihydrochromen-4-amine
SMILESCC1(C)CC(N)c2ccccc2O1
InChIInChI=1S/C11H15NO/c1-11(2)7-9(12)8-5-3-4-6-10(8)13-11/h3-6,9H,7,12H2,1-2H3
InChIKeyYSTIIIRGSQEQNH-UHFFFAOYSA-N
XLogP2.25
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,2-dimethyl-3,4-dihydrochromen-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-3,4-dihydrochromen-4-amine?
The IUPAC name of 2,2-dimethyl-3,4-dihydrochromen-4-amine (CID 15338705) is 2,2-dimethyl-3,4-dihydrochromen-4-amine.
What is the SMILES notation for 2,2-dimethyl-3,4-dihydrochromen-4-amine?
The canonical SMILES for 2,2-dimethyl-3,4-dihydrochromen-4-amine is CC1(C)CC(N)c2ccccc2O1.
What is the InChIKey of 2,2-dimethyl-3,4-dihydrochromen-4-amine?
The InChIKey is YSTIIIRGSQEQNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c1-11(2)7-9(12)8-5-3-4-6-10(8)13-11/h3-6,9H,7,12H2,1-2H3.
What are the key properties of 2,2-dimethyl-3,4-dihydrochromen-4-amine?
2,2-dimethyl-3,4-dihydrochromen-4-amine has a molecular weight of 177.25 g/mol, XLogP of 2.25, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-3,4-dihydrochromen-4-amine is sourced from PubChem (CID 15338705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).